SCHEMBL4199241

SCHEMBL4199241

CN(C)CCNC(=O)c1cccc(-c2cncc(Nc3ccc(Cl)cc3)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.55
ABL1 P00519 2/20 0.55
BCR P11274 2/20 0.55
MAPK8 P45983 1/20 0.50
MAPK10 P53779 1/20 0.50
MAPK14 Q16539 1/20 0.50
ADORA2A P29274 1/20 0.49
ADORA2B P29275 1/20 0.49
ADORA1 P30542 1/20 0.49
PDE4B Q07343 1/20 0.49
XDH P47989 1/20 0.47
SLC22A12 Q96S37 1/20 0.47
FYN P06241 3/20 0.47
MAP4K4 O95819 1/20 0.47
UTS2R Q9UKP6 4/20 0.47
PRKD3 O94806 1/20 0.47
PRKD1 Q15139 1/20 0.47
PRKD2 Q9BZL6 1/20 0.47
CCNT1 O60563 1/20 0.47
CCNE1 P24864 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4189128 0.89 BRAF (0.55) KDRABL1BCRMAPK8MAPK10
SCHEMBL4180405 0.88 FYN (0.62) KDRABL1BCRPDE4BXDH
SCHEMBL4194415 0.87 KDR (0.51) KDRABL1BCRMAPK8MAPK10
SCHEMBL4194386 0.87 ABL1 (0.49) KDRABL1BCRMAPK8MAPK10
SCHEMBL4152462 0.86 KDR (0.51) KDRABL1BCRMAPK8MAPK10
SCHEMBL5000392 0.84 KDR (0.74) KDRABL1BCRMAPK8MAPK10
SCHEMBL4194406 0.83 FYN (0.61) KDRABL1BCRFYNPRKD3
SCHEMBL4194279 0.82 KDR (0.49) KDRABL1BCRMAPK8MAPK10
SCHEMBL4182142 0.78 XDH (0.54) KDRABL1BCRMAPK8MAPK10
SCHEMBL4199338 0.78 KDR (0.57) KDRXDHSLC22A12FYNCSNK2A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090196912-A1 Pyridinylamines GPC BOTECH AG (DE) 2009-08-06 US claimed
EP-1789393-A2 PYRIDINYLAMINES GPC Biotech AG (DE) 2007-05-30 EP claimed
WO-2006010637-A2 PYRIDINYLAMINES GPC BIOTECH AG (DE) 2006-02-02 WO claimed
US-20200206188-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO BROWN DENNIS M (US) 2020-07-02 US disclosed
US-10383847-B2 Compositions and methods to improve the therapeutic benefit of indirubin and analogs thereof, including meisoindigo BROWN DENNIS M (US) 2019-08-20 US disclosed
US-20160243077-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO BROWN DENNIS M (US) 2016-08-25 US disclosed
US-20090196912-A1 Pyridinylamines GPC BOTECH AG (DE) 2009-08-06 US disclosed
EP-1789393-A2 PYRIDINYLAMINES GPC Biotech AG (DE) 2007-05-30 EP disclosed
WO-2006010637-A2 PYRIDINYLAMINES GPC BIOTECH AG (DE) 2006-02-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10383847-B2 Compositions and methods to improve the therapeutic benefit of indirubin and analogs thereof, including meisoindigo NEK9, NEK7, NEK3 KDR 4228/4885ABL1 1085/4885BCR 4304/4885
US-20200206188-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO NEK9, NEK7, NEK3 KDR 4228/4885ABL1 1085/4885BCR 4304/4885
US-20160243077-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO NEK9, NEK7, NEK3 KDR 4228/4885ABL1 1085/4885BCR 4304/4885
US-20090196912-A1 Pyridinylamines PRNP, PLPBP, SNCA KDR 3935/4885ABL1 2775/4885BCR 4551/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.